MetaADEDB 2.0 @ LMMD
benphothiamine
(BTNNPSLJPBRMLZ-LGMDPLHJSA-N)
Structure
SMILES
O=CN(/C(=C(\SC(=O)c1ccccc1)/CCOP(=O)(O)O)/C)Cc1cnc(nc1N)C
Type(s)
Approved; Experimental
ATC code(s)
A11DA03
Molecular Formula:
C19H23N4O6PS
Molecular Weight:
466.448
Log P:
3.8472
Hydrogen Bond Acceptor:
11
Hydrogen Bond Donor:
3
TPSA:
191.05
CAS Number(s):
137-74-6; 22457-89-2
Synonym(s)
1.
benphothiamine
2.
BTMP-benfo
3.
Neurostop
4.
S-benzoylthiamine monophosphate
5.
benfothiamine
6.
benfotiamine
7.
milgamma
External Link(s)
MeSHC013835
PubChem Compound3032771
ChEBI41039
DrugBankDB11748
DrugCentral308
KEGGdr:D01255
ZINC2015559
Adverse Drug Event(s)
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